(3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid
TL;DR: (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid (CAS 500770-76-3) is a chemical compound with molecular formula C14H18BrNO4 and molecular weight 343.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-(3-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: (R)-N-Boc-3-Bromo-beta-phenylalanine, (R)-3-(3-Bromophenyl)-3-((tert-butoxycarbonyl)amino)propanoic acid, Boc-D-?-Phe(3-Br)-OH, (R)-Boc-beta-Phe(3-Br)-OH, Boc-Phg(3-Br)-(C#CH2)OH
| Molecular Formula | C14H18BrNO4 |
|---|---|
| Molecular Weight | 343.04 g/mol |
| LogP | 3.4896 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.04193 |
| Heavy Atoms | 20 |
| Complexity | 496.1924 |
Chemical Identifiers
| CAS Number | 500770-76-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H](CC(=O)O)C1=CC(=CC=C1)Br |
Product Overview
(3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid (CAS 500770-76-3), with molecular formula C14H18BrNO4 and molecular weight 343.04 g/mol. IUPAC: (3R)-3-(3-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid
Property Insights of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid
The XLogP value of 3.4896 indicates that (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid. Following Lipinski's Rule of Five, (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid?
The CAS number of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid is 500770-76-3.
What is the molecular formula of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid?
The molecular formula of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid is C14H18BrNO4.
What is the molecular weight of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid?
The molecular weight of (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid is 343.04 g/mol.
Where can I buy (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid?
You can request a quote for (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3R)-3-(3-bromophenyl)-3-{[(tert-butoxy)carbonyl]amino}propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.